phenyl N-[2-(4-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]carbamate

Systemtic Name: phenyl N-[2-(4-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]carbamate Openeye Name: phenyl N-[2-(4-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]carbamate CAS Name: N-[2-(4-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]carbamic acid phenyl ester IUPAC Name: phenyl N-[2-(4-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]carbamate Traditional Name: N-[2-(4-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]carbamic acid phenyl ester Formula: C23H22N2O5S MolecularWeight: 438.49618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)OC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)OC4=CC=CC=C4

InChI

InChI=1S/C23H22N2O5S/c1-29-20-9-11-22(12-10-20)31(27,28)25-14-13-17-7-8-19(15-18(17)16-25)24-23(26)30-21-5-3-2-4-6-21/h2-12,15H,13-14,16H2,1H3,(H,24,26)